Acetone

Acetone

SCHEMBL5480449

CC(=O)CCO.CC(C)=O.CC(C)=O.CC(C)=O.CC(C)=O.CC(C)=O.CC(C)=O.CC(C)=O.CC(C)=O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
LMNA P02545 2/20 0.47
SLC15A2 Q16348 1/20 0.47
TDP1 Q9NUW8 2/20 0.41
PAOX Q6QHF9 3/20 0.39
ACHE P22303 1/20 0.39
TRPA1 O75762 1/20 0.39
CHRM1 P11229 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
CAMK2A Q9UQM7 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
TSHR P16473 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Acetone SCHEMBL3842229 1.00 ALDH1A1 (0.60) ALDH1A1LMNASLC15A2TDP1PAOX
Acetone SCHEMBL11150275 1.00 ALDH1A1 (0.60) ALDH1A1LMNASLC15A2TDP1PAOX
SCHEMBL40380 0.96
Methyl Alcohol SCHEMBL5132978 0.93 ALDH1A1 (0.60) ALDH1A1LMNASLC15A2TDP1PAOX
Methane SCHEMBL28805699 0.93
SCHEMBL29179529 0.93
SCHEMBL8105581 0.93
SCHEMBL129480 0.93
Hydrochloric Acid SCHEMBL3762402 0.93
SCHEMBL3871414 0.93

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024053316-A1 COMPOUND, EXTRACELLULAR VESICLE STAINING AGENT, AND FLUORESCENT STAINING METHOD FOR EXTRACELLULAR VESICLES 国立大学法人東海国立大学機構 2024-03-14 WO disclosed
CN-101400687-A Metal complex and organic electroluminescent element using same UNIV CHUO (JP) 2009-04-01 CN disclosed
US-20070210699-A1 Metal complex compound and organic electroluminescence device using the compound CHUO UNIVERSITY (JP) 2007-09-13 US disclosed
US-4835175-A Indole derivatives pharmaceutical preparations based thereon, and β-receptor stimulation therewith SCHERING AKTIENGESELLSCHAFT (DE) 1989-05-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070210699-A1 Metal complex compound and organic electroluminescence device using the compound EMC2, LAGE3, EPCAM ALDH1A1 2431/4885LMNA 1619/4885SLC15A2 3776/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.